Vitas-M small molecule compound
2-hydroxy-6-methyl-5-[(1E)-3-(octyloxy)-3-oxoprop-1-en-1-yl]-3-[2,3,5-tris-O-(phenylcarbonyl)pentofuranosyl]pyrimidin-4(3H)-one
Catalog ID
STK621766
SMILES CCCCCCCCOC(=O)/C=C/c1c(C)nc(n(c1=O)C1OC(C(C1OC(=O)c1ccccc1)OC(=O)c1ccccc1)COC(=O)c1ccccc1)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C42H44N2O11 MW 752.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H44N2O11/c1-3-4-5-6-7-17-26-51-34(45)25-24-32-28(2)43-42(50)44(37(32)46)38-36(55-41(49)31-22-15-10-16-23-31)35(54-40(48)30-20-13-9-14-21-30)33(53-38)27-52-39(47)29-18-11-8-12-19-29/h8-16,18-25,33,35-36,38H,3-7,17,26-27H2,1-2H3,(H,43,50)/b25-24InChIKey
GPSDMFFPRIIGBF-OCOZRVBESA-NSynonyms
CCCCCCCCOC(=O)C=Cc1c(C)nc(n(c1=O)C1OC(C(C1OC(=O)c1ccccc1)OC(=O)c1ccccc1)COC(=O)c1ccccc1)O
MFCD03807479
ZINC000150636727
ZINC000245255263
Check stock
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Check stock on Vitas-MAvailable files
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